6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine

C7H12N2O2 — CID 82719479

IUPAC6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine
SMILESCC1OCCC12CN=C(N)O2
InChIInChI=1S/C7H12N2O2/c1-5-7(2-3-10-5)4-9-6(8)11-7/h5H,2-4H2,1H3,(H2,8,9)
InChIKeyFZOUIHZZDXEALH-UHFFFAOYSA-N
MW156.18 g/mol
LogP-0.12
Rot. Bonds

About 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine

6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine (PubChem CID 82719479) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine.

Molecular Properties

Compound Name6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine
PubChem CID82719479
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Name6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine
SMILESCC1OCCC12CN=C(N)O2
InChIInChI=1S/C7H12N2O2/c1-5-7(2-3-10-5)4-9-6(8)11-7/h5H,2-4H2,1H3,(H2,8,9)
InChIKeyFZOUIHZZDXEALH-UHFFFAOYSA-N
XLogP-0.12
TPSA56.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine?
The IUPAC name of 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine (CID 82719479) is 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine.
What is the SMILES notation for 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine?
The canonical SMILES for 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine is CC1OCCC12CN=C(N)O2.
What is the InChIKey of 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine?
The InChIKey is FZOUIHZZDXEALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5-7(2-3-10-5)4-9-6(8)11-7/h5H,2-4H2,1H3,(H2,8,9).
What are the key properties of 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine?
6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine has a molecular weight of 156.18 g/mol, XLogP of -0.12, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,7-dioxa-3-azaspiro[4.4]non-2-en-2-amine is sourced from PubChem (CID 82719479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).